SCHEMBL7475452

SCHEMBL7475452

O=[N+]([O-])c1cc2c(NC(OCc3ccccc3)c3ccccc3)ncnc2cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 10/20 0.52
PDGFRB P09619 1/20 0.42
PIN1 Q13526 1/20 0.42
ABCG2 Q9UNQ0 1/20 0.42
FBP1 P09467 1/20 0.40
KRAS P01116 1/20 0.39
SOS1 Q07889 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7465511 0.85 EGFR (0.48) EGFRPDGFRBABCG2FBP1KRAS
SCHEMBL7460928 0.82 HTR6 (0.41) EGFRPDGFRBABCG2
SCHEMBL7473900 0.81 EGFR (0.56) EGFRPDGFRBABCG2KRASSOS1
SCHEMBL7466558 0.79 EGFR (0.46) EGFRPDGFRBABCG2FBP1KRAS
SCHEMBL7474113 0.79 EGFR (0.55) EGFRPDGFRBABCG2FBP1
SCHEMBL7475194 0.78 EGFR (0.66) EGFR
SCHEMBL7470644 0.78 EGFR (0.53) EGFRPDGFRBABCG2KRASSOS1
SCHEMBL7460996 0.77 EGFR (0.48) EGFRPDGFRBABCG2FBP1KRAS
SCHEMBL7475448 0.77 EGFR (0.56) EGFR
SCHEMBL7474181 0.77 MAPK1 (0.56) EGFR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1229025-A1 NOVEL QUINAZOLINE DERIVATIVES Japan Energy Corporation (JP) 2002-08-07 EP disclosed